COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL478932
Chemical Name: 4-[(1E)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]-2-methoxyphenyl4-bromobenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)Br)/C(=O)NCc1ccccc1

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Molecular Weight: 491.34
Empirical Formula: C25H19BrN2O4

Available Amount: 0 mg

Lipinsky:
logP: 5.398
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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